Technetium
version 1
  • Tc param
  • Tc OPIUM report file
  • Tc psp in abinit (fhi) format
    		•  tests 1
  • Calculation for bulk (hcp):
    • Tc Energy vs. Volume Plot
    Experimental Lattice Constant: 2.74, 4.40 Å
    Lattice Constant Error:3.31, 0.875 %
    Experimental Bulk Modulus: 2.97 N/m2
    Bulk Modulus Error: -14.2501 %

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